sodium;benzyl-[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]carbamodithioic acid
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![sodium;benzyl-[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]carbamodithioic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/2fb7dceceddf48fca2bebcd0e7aa44d8.png "sodium;benzyl-[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]carbamodithioic acid")
sodium;benzyl-[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]carbamodithioic acid
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CAS No:
102996-80-5
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Formula:
C14H21NNaO5S2+
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Chemical Name:
sodium;benzyl-[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]carbamodithioic acid
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Synonyms:
benzylglucamine-N-carbodithioate;BGDTC;N-benzyl-N-dithiocarboxy-D-glucamine;N-benzylglucamine dithiocarbamate;N-benzylglucamine dithiocarbamate, sodium salt;NBG-DTC;Nbg-dtc;Sodium N-benzyl-D-glucamine dithiocarbamate hydrate;Sodium N-benzyl-D-glucaminedithiocarbamate;Sodium N-benzyl-D-glucamine dithiocarbamate;N-Benzyl-N-dithiocarboxy-D-glucamine sodium salt hydrate;1-Deoxy-1-((dithiocarboxy)(phenylmethyl)amino)-D-glucitol monosodium salt hydrate;1-Deoxy-1-((dithiocarboxy)(phenylmethyl)amino)-D-glucitol monosodium salt monohydrate;D-Glucitol, 1-deoxy-1-((dithiocarboxy)(phenylmethyl)amino)-, monosodium salt, hydrate;102996-80-5
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CAS No:
sodium;benzyl-[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]carbamodithioic acid Basic Attributes
370.4 g/mol
370.07588440 g/mol
Drug Information
Chemicals that bind to and remove ions from solutions. Many chelating agents function through the formation of COORDINATION COMPLEXES with METALS. (See all compounds classified as Chelating Agents.)
benzylglucamine-N-carbodithioate
Computed Properties
Molecular Weight:370.4
Hydrogen Bond Donor Count:6
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:8
Exact Mass:370.07588440
Monoisotopic Mass:370.07588440
Topological Polar Surface Area:138
Heavy Atom Count:23
Formal Charge:1
Complexity:341
Defined Atom Stereocenter Count:4
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes
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